UCSF

ZINC15444622

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2008 11 No

Popular Name: 3,6-Difluoro-2-hydroxybenzaldehyde 3,6-Difluoro-2-hydroxybenzaldehyde

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CAS Numbers: 502762-92-7 , [502762-92-7]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.69 1.6 -8.63 1 2 0 37 158.103 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 71-76° Oakwood Chemical
Melting_Point 73-77? Alfa-Aesar
Melting_Point 73-77° Alfa-Aesar
Purity 95% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )